CID 103037308

En300-5183965

Structural Information

Molecular Formula
C6H13BF3O
SMILES
[B-](CCC(C)(C)OC)(F)(F)F
InChI
InChI=1S/C6H13BF3O/c1-6(2,11-3)4-5-7(8,9)10/h4-5H2,1-3H3/q-1
InChIKey
VLEGAHHFHFSXRG-UHFFFAOYSA-N
Compound name
trifluoro-(3-methoxy-3-methylbutyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.10115 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.10843 132.3
[M+Na]+ 192.09037 140.0
[M-H]- 168.09387 127.3
[M+NH4]+ 187.13497 152.6
[M+K]+ 208.06431 139.6
[M+H-H2O]+ 152.09841 128.6
[M+HCOO]- 214.09935 149.3
[M+CH3COO]- 228.11500 177.9
[M+Na-2H]- 190.07582 137.9
[M]+ 169.10060 128.4
[M]- 169.10170 128.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.